SCHEMBL7227149

SCHEMBL7227149

COC(=O)C(C)Oc1ccc(Oc2cc(-n3c(=O)cc(C(F)(F)F)n(C)c3=O)c(F)cc2Cl)cc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
DHODH Q02127 10/20 0.36
PPOX P50336 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
POLB P06746 1/20 0.35
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
BRAF P15056 1/20 0.33
SCN9A Q15858 2/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7234497 0.93 DHODH (0.38) DHODHPPOXALDH1A1
SCHEMBL7227543 0.92 PPOX (0.45) KMT2AL3MBTL1DHODHPPOXSMN1; SMN2
SCHEMBL12981626 0.90 PPOX (0.43) DHODHPPOXSMN1; SMN2KDM4EALDH1A1
SCHEMBL7178022 0.90 PPOX (0.43) DHODHPPOXSMN1; SMN2KDM4EALDH1A1
SCHEMBL6644418 0.90 ACACB (0.36) MEN1MAPTKMT2AL3MBTL1DHODH
SCHEMBL7227471 0.89 POLB (0.36) MEN1MAPTKMT2AL3MBTL1DHODH
SCHEMBL3140584 0.89 BCAT1 (0.38) DHODHPPOX
SCHEMBL6639012 0.88 DHODH (0.34) MEN1MAPTKMT2AL3MBTL1DHODH
SCHEMBL6637980 0.86 DHODH (0.39) DHODH
SCHEMBL7221822 0.86 DHODH (0.37) DHODHPPOXALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6667413-B2 Aniline derivatives; herbicides; nonphytotoxic SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-12-23 US disclosed
US-20030130124-A1 Herbicides SUMITOMO CHEMICAL COMPANY, LIMITED 2003-07-10 US disclosed
US-6451740-B2 HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-09-17 US disclosed
US-20020013466-A1 Uracil compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-01-31 US disclosed
EP-1106607-A2 Uracil compounds and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-06-13 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030130124-A1 Herbicides CBR3, CBR1, MT-CO1 MEN1 3863/4885MAPT 4776/4885KMT2A 1323/4885
US-20020013466-A1 Uracil compounds and use thereof UNG, MRM1, OGG1 MEN1 2823/4885MAPT 4788/4885KMT2A 2006/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.